General Information of the Compound
| Compound ID |
CP0569553
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-fluoro-4-[[7-(1-methylpiperidin-4-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]oxy]phenyl]-3-(4-fluorophenyl)-2,4-dioxo-1-propan-2-ylpyrimidine-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C33H35F2N7O4
|
||||||||||||||||||
| Molecular Weight |
631.684
|
||||||||||||||||||
| Canonical SMILES |
CC(C)n1cc(C(=O)Nc2ccc(Oc3ncnc4CN(CCc34)C3CCN(C)CC3)c(F)c2)c(=O)n(-c2ccc(F)cc2)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C33H35F2N7O4/c1-20(2)41-17-26(32(44)42(33(41)45)24-7-4-21(34)5-8-24)30(43)38-22-6-9-29(27(35)16-22)46-31-25-12-15-40(18-28(25)36-19-37-31)23-10-13-39(3)14-11-23/h4-9,16-17,19-20,23H,10-15,18H2,1-3H3,(H,38,43)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RYQKZEFCGLDZCP-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT07205, Tyrosine-protein kinase Mer
Protein ID: PT07477, Tyrosine-protein kinase receptor UFO